4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine

C11H17ClN4O — CID 62858345

IUPAC4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(Cl)nc(NC2(C)CCCCC2)n1
InChIInChI=1S/C11H17ClN4O/c1-11(6-4-3-5-7-11)16-9-13-8(12)14-10(15-9)17-2/h3-7H2,1-2H3,(H,13,14,15,16)
InChIKeyMOMCDRKXJHFYFE-UHFFFAOYSA-N
MW256.74 g/mol
LogP2.67
Rot. Bonds3

About 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine

4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine (PubChem CID 62858345) has the molecular formula C11H17ClN4O and a molecular weight of 256.74 g/mol. Its IUPAC name is 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine
PubChem CID62858345
Molecular FormulaC11H17ClN4O
Molecular Weight256.74 g/mol
Exact Mass256.11
IUPAC Name4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(Cl)nc(NC2(C)CCCCC2)n1
InChIInChI=1S/C11H17ClN4O/c1-11(6-4-3-5-7-11)16-9-13-8(12)14-10(15-9)17-2/h3-7H2,1-2H3,(H,13,14,15,16)
InChIKeyMOMCDRKXJHFYFE-UHFFFAOYSA-N
XLogP2.67
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.74
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[4-Chloro-6-(methoxyamino)-1,3,5-triazin-2-yl]amino]cyclohexane-1-carbonitrile
CID 71727499
1-[[4-Methoxy-6-(methylamino)-1,3,5-triazin-2-yl]amino]cyclohexane-1-carbonitrile
CID 71727505
1-[(4-Amino-6-chloro-1,3,5-triazin-2-yl)amino]cyclohexane-1-carbonitrile
CID 71727403
4,6-dichloro-N-(2-methylheptan-2-yl)-1,3,5-triazin-2-amine
CID 11644801
4,6-dimethoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 19832808
2-N,4-N-bis(1-methylcyclohexyl)-1,3,5-triazine-2,4,6-triamine
CID 23295152
2-N-(3-methylheptan-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 57140276
6-chloro-2-N,4-N-bis(3-methyloctan-3-yl)-1,3,5-triazine-2,4-diamine
CID 122498476
4,6-dimethoxy-N-(7-methyltetradecan-7-yl)-1,3,5-triazin-2-amine
CID 169970573
4-chloro-6-ethoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 55124418
4-chloro-N-(cyclohexylmethyl)-6-methoxy-1,3,5-triazin-2-amine
CID 55124638
6-chloro-2-N,2-N-dimethyl-4-N-(1-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
CID 55125514

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine (CID 62858345) is 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine is COc1nc(Cl)nc(NC2(C)CCCCC2)n1.
What is the InChIKey of 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine?
The InChIKey is MOMCDRKXJHFYFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN4O/c1-11(6-4-3-5-7-11)16-9-13-8(12)14-10(15-9)17-2/h3-7H2,1-2H3,(H,13,14,15,16).
What are the key properties of 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine?
4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine has a molecular weight of 256.74 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-methoxy-N-(1-methylcyclohexyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 62858345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).